Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.31 |
| ▸ | PLAU | P00749 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29143112 | 1.00 | GBA1 (0.34) | GBA1ALDH1A1KDM4EESR1ESR2 | |
| SCHEMBL29876357 | 1.00 | GBA1 (0.34) | GBA1ALDH1A1KDM4EESR1ESR2 | |
| SCHEMBL17364436 | 0.81 | GBA1 (0.41) | GBA1ALDH1A1KDM4EESR1ESR2 | |
| SCHEMBL29143120 | 0.78 | KDM4E (0.41) | ALDH1A1KDM4ES1PR4S1PR3RAB9A | |
| SCHEMBL29143124 | 0.78 | KDM4E (0.41) | ALDH1A1KDM4ES1PR4S1PR3RAB9A | |
| SCHEMBL29876470 | 0.78 | KDM4E (0.41) | ALDH1A1KDM4ES1PR4S1PR3RAB9A | |
| SCHEMBL31541656 | 0.75 | GBA1 (0.36) | GBA1ALDH1A1KDM4EADRA2AADRA2B | |
| SCHEMBL14102858 | 0.75 | GBA1 (0.36) | GBA1ALDH1A1KDM4EADRA2AADRA2B | |
| SCHEMBL5144483 | 0.74 | ESR1 (0.42) | GBA1ALDH1A1KDM4EESR1ESR2 | |
| SCHEMBL15006213 | 0.74 | GBA1 (0.35) | GBA1ALDH1A1KDM4EADRA2AADRA2B |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117412972-A | Selective modulators of Ataxia Telangiectasia Mutated (ATM) kinase and uses thereof | 苏州赞荣医药科技有限公司 | 2024-01-16 | — | — | CN | disclosed |